5-hydroxy-8H-imidazo[1,2-a]pyrimidin-7-one

C6H5N3O2 — CID 13465980

IUPAC5-hydroxy-8H-imidazo[1,2-a]pyrimidin-7-one
SMILESO=c1cc(O)n2ccnc2[nH]1
InChIInChI=1S/C6H5N3O2/c10-4-3-5(11)9-2-1-7-6(9)8-4/h1-3,11H,(H,7,8,10)
InChIKeyBELWUABPSOOYPK-UHFFFAOYSA-N
MW151.12 g/mol
LogP-0.27
Rot. Bonds

About 5-hydroxy-8H-imidazo[1,2-a]pyrimidin-7-one

5-hydroxy-8H-imidazo[1,2-a]pyrimidin-7-one (PubChem CID 13465980) has the molecular formula C6H5N3O2 and a molecular weight of 151.12 g/mol. Its IUPAC name is 5-hydroxy-8H-imidazo[1,2-a]pyrimidin-7-one.

Molecular Properties

Compound Name5-hydroxy-8H-imidazo[1,2-a]pyrimidin-7-one
PubChem CID13465980
Molecular FormulaC6H5N3O2
Molecular Weight151.12 g/mol
Exact Mass151.04
IUPAC Name5-hydroxy-8H-imidazo[1,2-a]pyrimidin-7-one
SMILESO=c1cc(O)n2ccnc2[nH]1
InChIInChI=1S/C6H5N3O2/c10-4-3-5(11)9-2-1-7-6(9)8-4/h1-3,11H,(H,7,8,10)
InChIKeyBELWUABPSOOYPK-UHFFFAOYSA-N
XLogP-0.27
TPSA70.39 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.12
LogP ≤ 5-0.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-hydroxy-8H-imidazo[1,2-a]pyrimidin-7-one?
The IUPAC name of 5-hydroxy-8H-imidazo[1,2-a]pyrimidin-7-one (CID 13465980) is 5-hydroxy-8H-imidazo[1,2-a]pyrimidin-7-one.
What is the SMILES notation for 5-hydroxy-8H-imidazo[1,2-a]pyrimidin-7-one?
The canonical SMILES for 5-hydroxy-8H-imidazo[1,2-a]pyrimidin-7-one is O=c1cc(O)n2ccnc2[nH]1.
What is the InChIKey of 5-hydroxy-8H-imidazo[1,2-a]pyrimidin-7-one?
The InChIKey is BELWUABPSOOYPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5N3O2/c10-4-3-5(11)9-2-1-7-6(9)8-4/h1-3,11H,(H,7,8,10).
What are the key properties of 5-hydroxy-8H-imidazo[1,2-a]pyrimidin-7-one?
5-hydroxy-8H-imidazo[1,2-a]pyrimidin-7-one has a molecular weight of 151.12 g/mol, XLogP of -0.27, 0 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydroxy-8H-imidazo[1,2-a]pyrimidin-7-one is sourced from PubChem (CID 13465980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).